SCHEMBL3026147

SCHEMBL3026147

CNC(=O)COc1ccc(Nc2nnc(-c3ccc(C)cc3)c3ccccc23)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.68
TP53 P04637 3/20 0.68
THRB P10828 2/20 0.68
SMN1; SMN2 Q16637 2/20 0.68
GAA P10253 1/20 0.67
POLB P06746 2/20 0.65
NPSR1 Q6W5P4 1/20 0.62
KDR P35968 2/20 0.62
KMT2A Q03164 2/20 0.58
ALDH1A1 P00352 2/20 0.58
HTT P42858 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
MTOR P42345 1/20 0.58
NPC1 O15118 1/20 0.57
ENPP3 O14638 2/20 0.56
MEN1 O00255 1/20 0.56
CA2 P00918 1/20 0.56
CA9 Q16790 1/20 0.56
LMNA P02545 1/20 0.55
KLK7 P49862 1/20 0.55

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3028283 0.93 MAPT (0.67) MAPTTP53THRBSMN1; SMN2GAA
SCHEMBL3017604 0.84 KMT2A (0.84) MAPTTP53THRBSMN1; SMN2POLB
SCHEMBL3030662 0.83 MAPT (0.86) MAPTTP53THRBSMN1; SMN2GAA
SCHEMBL7918523 0.81 MAPT (0.61) MAPTTP53THRBGAAPOLB
SCHEMBL7918566 0.80 ENPP3 (0.76) MAPTTP53THRBGAAPOLB
SCHEMBL3027890 0.80 MAPT (1.00) MAPTTP53THRBSMN1; SMN2GAA
SCHEMBL15077148 0.78 KDR (0.81) MAPTTP53THRBPOLBNPSR1
SCHEMBL7915100 0.78 KDR (0.72) MAPTPOLBNPSR1KDRKMT2A
SCHEMBL7912087 0.77 KDR (0.78) TP53THRBGAAPOLBNPSR1
SCHEMBL3021915 0.77 KDR (1.00) POLBNPSR1KDRKMT2AALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9316633-B2 Methods for identifying inhibitors of solute transporters THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-04-19 US disclosed
US-20100190796-A1 METHODS FOR IDENTIFYING INHIBITORS OF SOLUTE TRANSPORTERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-07-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100190796-A1 METHODS FOR IDENTIFYING INHIBITORS OF SOLUTE TRANSPORTERS SLC2A1, SLC2A3, SLC2A8 MAPT 1849/4885TP53 1348/4885THRB 3545/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.